SCHEMBL20608495

SCHEMBL20608495

Cc1nc(N)c2c(n1)CN(C(=O)O)C2

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.34
CYP1A2 P05177 1/20 0.34
P2RX7 Q99572 3/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20608471 0.80 CHRM4 (0.34) CHRM4CYP1A2P2RX7
SCHEMBL20608461 0.79 C5AR1 (0.39)
SCHEMBL28886592 0.75 ALDH1A1 (0.33)
SCHEMBL29496236 0.72 CHRM4 (0.35) CHRM4CYP1A2
SCHEMBL12811481 0.71 NOTUM (0.35) CHRM4CYP1A2P2RX7
SCHEMBL17106485 0.71 CYP1A2 (0.35) CHRM4CYP1A2P2RX7
SCHEMBL19547099 0.71 P2RX7 (0.42) P2RX7
SCHEMBL29496297 0.70 CHRM4 (0.63) CHRM4CYP1A2
SCHEMBL3241010 0.70 P2RX7 (0.34) P2RX7
SCHEMBL23234134 0.70 CYP1A2 (0.32) CHRM4CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10683269-B2 2-cyanoisoindoline derivatives for treating cancer MISSION THERAPEUTICS LIMITED (GB) 2020-06-16 US disclosed
US-20190010122-A1 2-CYANOISOINDOLINE DERIVATIVES FOR TREATING CANCER MISSION THERAPEUTICS LIMITED (GB) 2019-01-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190010122-A1 2-CYANOISOINDOLINE DERIVATIVES FOR TREATING CANCER USP7, USP47, USP2 CHRM4 4219/4885CYP1A2 893/4885P2RX7 4141/4885
US-10683269-B2 2-cyanoisoindoline derivatives for treating cancer USP7, USP47, USP2 CHRM4 4219/4885CYP1A2 893/4885P2RX7 4141/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.